Geometry & MOs

Info

ID:	328666
PubChem CID:	126726419
Reduced:	N3O4C27H27 (1)
Stoich.:	A3B4C27D27 (1)
Weight, g/mol:	417.185255
ΔH_f, kcal/mol:	-57.6
Dipole, Da:	3.71
IP(EA), eV:	-9.36(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-N-(2-fluoroethyl)-2-[hydroxy(diphenyl)methyl]benzimidazole-5-carboxamide

Drug info:

PubChemData

Smile

C[C@H](CNC(=O)C1=CC2=C(C=C1)N=C(N2C3COC3)C(C4=CC=CC=C4)(C5=CC=CC=C5)O)O

DOS

IR

Vibrations